(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3,11-bis(oxidanylidene)-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid

Systemtic Name: (8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3,11-bis(oxidanylidene)-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid Openeye Name: (8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3,11-dioxo-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid CAS Name: (8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3,11-dioxo-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid IUPAC Name: (8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3,11-dioxo-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid Traditional Name: (8S,9S,10R,13S,14S,17S)-3,11-diketo-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid Formula: C20H26O4 MolecularWeight: 330.41804

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(=O)C=C1CCC3C2C(=O)CC4(C3CCC4C(=O)O)C

Isomeric SMILES

C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CC[C@@H]4C(=O)O)C

InChI

InChI=1S/C20H26O4/c1-19-8-7-12(21)9-11(19)3-4-13-14-5-6-15(18(23)24)20(14,2)10-16(22)17(13)19/h9,13-15,17H,3-8,10H2,1-2H3,(H,23,24)/t13-,14-,15+,17+,19-,20-/m0/s1